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Substance Name: 3'-Deoxybutirosin A
RN: 55528-48-8
InChIKey: UBDPTYWUITYXPX-AHTHHIITSA-N

Molecular Formula

  • C21-H41-N5-O11

Molecular Weight

  • 539.5789
 
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Names and Synonyms

Name of Substance

  • 3'-Deoxybutirosin A

Systematic Name

  • D-Streptamine, O-2,6-diamino-2,3,6-trideoxy-alpha-D-ribo-hexopyranosyl-(1-4)-O-(beta-D-xylofuranosyl-(1-5))-N1-(4-amino-2-hydroxy-1-oxobutyl)-2-deoxy-, (S)-

Registry Numbers

CAS Registry Number

  • 55528-48-8

System Generated Number

  • 0055528488

Structure Descriptors

InChI

1S/C21H41N5O11/c22-2-1-10(28)19(33)26-9-3-7(24)17(36-20-8(25)4-11(29)12(5-23)34-20)18(14(9)30)37-21-16(32)15(31)13(6-27)35-21/h7-18,20-21,27-32H,1-6,22-25H2,(H,26,33)/t7-,8+,9+,10-,11-,12+,13+,14-,15-,16+,17+,18+,20+,21-/m0/s1

InChIKey

UBDPTYWUITYXPX-AHTHHIITSA-N

Smiles

NCC[C@H](O)C(=O)N[C@@H]1C[C@H](N)[C@@H](O[C@H]2O[C@H](CN)[C@@H](O)C[C@H]2N)[C@H](O[C@@H]3O[C@H](CO)[C@H](O)[C@H]3O)[C@H]1O